Geometry & MOs

Info

ID:	409976
PubChem CID:	135082763
Reduced:	ClNO6C12H18 (1)
Stoich.:	ABC6D12E18 (1)
Weight, g/mol:	324.962004
ΔH_f, kcal/mol:	-223.74
Dipole, Da:	2.11
IP(EA), eV:	-9.92(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-aminooxy-3-(3,4-dichlorophenoxy)propan-2-ol;dihydrochloride

Drug info:

PubChemData

Smile

CC1(OC[C@H](O1)[C@H]2[C@@H]3[C@H](C(O2)(N=O)Cl)OC(O3)(C)C)C

DOS

IR

Vibrations